SCHEMBL11117502

CCC(NC(=O)CO[C@H]1[C@H](O)[C@@H](CO)O[C@H](OCc2ccccc2)[C@@H]1NC(=O)C(C)C)C(=O)NC(CCC(=O)OC(C)(C)C)C(N)=O

nearest known ligand 0.38

Predicted protein targets (top 11)

	gene	UniProt	supporting neighbours	confidence
▸	ANPEP	P15144	2/20	0.38

▸	SSTR1	P30872	1/20	0.37

▸	SSTR2	P30874	1/20	0.37

▸	SSTR4	P31391	1/20	0.37

▸	SSTR3	P32745	1/20	0.37

▸	SSTR5	P35346	1/20	0.37

▸	MCHR1	Q99705	13/20	0.37

▸	NOD2	Q9HC29	1/20	0.37

▸	OPRM1	P35372	1/20	0.36

▸	OPRD1	P41143	1/20	0.36

▸	REN	P00797	1/20	0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compound	similarity	top predicted	shared targets
SCHEMBL10832555	0.93	NOD2 (0.42)	ANPEPSSTR1SSTR2SSTR4SSTR3
SCHEMBL10831494	0.92	NOD2 (0.44)	ANPEPSSTR1SSTR2SSTR4SSTR3
SCHEMBL10832236	0.85	NOD2 (0.50)	ANPEPSSTR1SSTR2SSTR4SSTR3
SCHEMBL10832327	0.80	NOD2 (0.57)	ANPEPSSTR1SSTR2SSTR4SSTR3
SCHEMBL10831595	0.77	L3MBTL1 (0.40)	REN
SCHEMBL10832206	0.76	L3MBTL1 (0.36)	REN
SCHEMBL14612260	0.76	NOD2 (0.53)	ANPEPNOD2OPRM1OPRD1
SCHEMBL10831526	0.74	NOD2 (0.52)	ANPEPNOD2
SCHEMBL11113553	0.74	NOD2 (0.49)	ANPEPNOD2OPRM1OPRD1
SCHEMBL11116037	0.73	ESR1 (0.52)	ANPEPNOD2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-4446128-A	Antigen derivatives and processes for their preparation	CIBA-GEIGY CORPORATION (US)	1984-05-01	—	—	US	disclosed